Home Aminos Benzeneethanol, β-(methylamino)-, hydrochloride (1:1), (βS)-

Benzeneethanol, β-(methylamino)-, hydrochloride (1:1), (βS)-

CAS No.:
1810074-71-5
Catalog Number:
AG0022LU
Molecular Formula:
C9H14ClNO
Molecular Weight:
187.6666
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Product Description
Catalog Number:
AG0022LU
Chemical Name:
Benzeneethanol, β-(methylamino)-, hydrochloride (1:1), (βS)-
CAS Number:
1810074-71-5
Molecular Formula:
C9H14ClNO
Molecular Weight:
187.6666
MDL Number:
MFCD28986167
IUPAC Name:
(2S)-2-(methylamino)-2-phenylethanol;hydrochloride
InChI:
InChI=1S/C9H13NO.ClH/c1-10-9(7-11)8-5-3-2-4-6-8;/h2-6,9-11H,7H2,1H3;1H/t9-;/m1./s1
InChI Key:
PUYJUPCZJUYIKT-SBSPUUFOSA-N
SMILES:
OC[C@H](c1ccccc1)NC.Cl
Properties
Complexity:
99.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
187.076g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
187.667g/mol
Monoisotopic Mass:
187.076g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties